[2-[(2-acetamido-6-oxidanylidene-3H-purin-9-yl)methoxy]-3-oxidanyl-propyl] ethanoate

Systemtic Name: [2-[(2-acetamido-6-oxidanylidene-3H-purin-9-yl)methoxy]-3-oxidanyl-propyl] ethanoate Openeye Name: [2-[(2-acetamido-6-oxo-3H-purin-9-yl)methoxy]-3-hydroxy-propyl] acetate CAS Name: acetic acid [2-[(2-acetamido-6-oxo-3H-purin-9-yl)methoxy]-3-hydroxypropyl] ester IUPAC Name: [2-[(2-acetamido-6-oxo-3H-purin-9-yl)methoxy]-3-hydroxypropyl] acetate Traditional Name: acetic acid [2-[(2-acetamido-6-keto-3H-purin-9-yl)methoxy]-3-hydroxy-propyl] ester Formula: C13H17N5O6 MolecularWeight: 339.30398

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=O)C2=C(N1)N(C=N2)COC(CO)COC(=O)C

Isomeric SMILES

CC(=O)NC1=NC(=O)C2=C(N1)N(C=N2)COC(CO)COC(=O)C

InChI

InChI=1S/C13H17N5O6/c1-7(20)15-13-16-11-10(12(22)17-13)14-5-18(11)6-24-9(3-19)4-23-8(2)21/h5,9,19H,3-4,6H2,1-2H3,(H2,15,16,17,20,22)